Vuf-6002

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Properties Simple | Detailed

Formula C13H15ClN4O
IUPAC Name (5-chlorobenzimidazol-3-ium-2-ylium-2-yl)-(4-methylpiperazin-1-yl)methanone
Molecular Mass 278.737 g·mol−1
Heat of Formation 39.0 ± 16.7 kJ·mol−1
Dipole Moment 2.26 ± 1.08 D
Volume 316.57 Å 3
Surface Area 288.11 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy -1.34 ± eV
Point Group Symmetry C1
Synonyms
  • (6-chloro-1h-benzimidazol-2-yl)-(4-methyl-1-piperazinyl)methanone
  • (6-chloro-1h-benzimidazol-2-yl)-(4-methylpiperazin-1-yl)methanone
InChIKey MOIWSUQWIOVGRH-UHFFFAOYSA-N
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Elements H C N O Cl